Mol:BMSUM6Ue--06

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Copyright: ARM project http://www.metabolome.jp/
 17 16  0  0  1  0  0  0  0  0999 V2000
    5.5981    3.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5981    2.0000    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.7321    1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7321    0.5000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.8660   -0.0000    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.8660   -1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7321    3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4641    3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4641    1.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8660    2.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5981   -0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0000    0.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0000   -1.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0000   -2.5000    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    4.0000   -2.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -2.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0000   -3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  7  1  1  0  0  0  0
  1  8  2  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2  9  1  1  0  0  0
  3  4  1  0  0  0  0
  3 10  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  4 11  1  6  0  0  0
  5 12  1  6  0  0  0
  6 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  2  0  0  0  0
 14 17  1  0  0  0  0
S  SKP  6
ID	BMSUM6Ue--06
NAME	3-Dehydro-L-gulonate 6-phosphate
FORMULA	C6H11O10P
EXACTMASS	274.0089
AVERAGEMASS	274.1193
SMILES	OC(=O)[C@@H](O)C(=O)[C@H](O)[C@@H](O)COP(O)(O)=O
M  END

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